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CHEBI:44144 - 4-[(4-methylpiperazin-1-yl)methyl]-N-{3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl}benzamide

ChEBI IDCHEBI:44144
ChEBI Name4-[(4-methylpiperazin-1-yl)methyl]-N-{3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl}benzamide
Stars
ASCII Name4-[(4-methylpiperazin-1-yl)methyl]-N-{3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl}benzamide
Last Modified17 October 2009
DownloadsMolfile
FormulaC28H29N7O
Net Charge0
Average Mass479.588
Monoisotopic Mass479.24336
SMILES[H]c1nc(N([H])c2c([H])c([H])c([H])c(N([H])C(=O)c3c([H])c([H])c(C([H])([H])N4C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])C4([H])[H])c([H])c3[H])c2[H])nc(-c2c([H])nc([H])c([H])c2[H])c1[H]
InChIInChI=1S/C28H29N7O/c1-34-14-16-35(17-15-34)20-21-7-9-22(10-8-21)27(36)31-24-5-2-6-25(18-24)32-28-30-13-11-26(33-28)23-4-3-12-29-19-23/h2-13,18-19H,14-17,20H2,1H3,(H,31,36)(H,30,32,33)
InChIKeyJHMBUEWQJDGKGS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[(4-methylpiperazin-1-yl)methyl]-N-{3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl}benzamide (CHEBI:44144) is a N-methylpiperazine (CHEBI:46920)
4-[(4-methylpiperazin-1-yl)methyl]-N-{3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl}benzamide (CHEBI:44144) is a benzamides (CHEBI:22702)
4-[(4-methylpiperazin-1-yl)methyl]-N-{3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl}benzamide (CHEBI:44144) is a pyrimidylpyridine (CHEBI:46909)
Synonyms  Source
4-[(4-METHYLPIPERAZIN-1-YL)METHYL]-N-{3-[(4-PYRIDIN-3-YLPYRIMIDIN-2-YL)AMINO]PHENYL}BENZAMIDEPDBeChem
4-[(4-methylpiperazin-1-yl)methyl]-N-{3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl}benzamidePDBeChem
Manual XrefsDatabases
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